P396-0744 Screening compound: 3-methoxy-1-{3-[(3-morpholino-2-pyrazinyl)oxy]-1-pyrrolidinyl}-1-propanone
Chemical Structure Depiction of ChemDiv screening compound P396-0744
3-methoxy-1-{3-[(3-morpholino-2-pyrazinyl)oxy]-1-pyrrolidinyl}-1-propanone
Available from 1 mg
Formats:
- Glass Vials (4ml Glass Vials VWR #97047-678)
- 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)
Shiptime: 1 week worldwide delivery in most cases
Compound Identifiers
ChemDiv Compound ID
P396-0744
Molecular Formula
C16H24N4O4 (C16 H24 N4 O4)
Compound Name
3-methoxy-1-{3-[(3-morpholino-2-pyrazinyl)oxy]-1-pyrrolidinyl}-1-propanone
IUPAC name
3-methoxy-1-(3-{[3-(morpholin-4-yl)pyrazin-2-yl]oxy}pyrrolidin-1-yl)propan-1-one
SMILES
COCCC(N(CC1)CC1Oc1nccnc1N1CCOCC1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
336.39
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
0.361
Distribution Coefficient, logD
0.361
Water Solubility, LogSw
-0.82
Polar Surface Area
61.682
Acid Dissociation Constant (pKa)
23.81
Base Dissociation Constant (pKb)
2.73
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
68.75
P396-0744 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
GPCR Targeted Library (31838 compounds)
Ligand-Gated Ion Channels Library (3887 compounds)
PI3K-Targeted Library (17255 compounds)
MDM2-p53 interaction inhibitors Library (21687 compounds)
Included in 1.7M Stock Database
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- Nervous system
- Eye
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Male
- Female
- Hemic and lymphatic
- Skin
- Cancer
- GPCR
- Ion Channels
- Kinases
- Receptor's ligands
- PPI modulators
References: we are preparing a list of scientific research reports with P396-0744 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)